Dehydro Aripiprazole-d8 Hydrochloride

Analyte Name

Dehydroaripiprazole piperazinyl-2,2,3,3,5,5,6,6-d8 hydrochloride

CAS Number

1215383-78-0

Molecular Formula

C23 2H8 H17 Cl2 N3 O2 . Cl H

Molecular Weight

490.88

Accurate Mass

489.1593

SMILES

Cl.[2H]C1([2H])N(CCCCOc2ccc3C=CC(=O)Nc3c2)C([2H])([2H])C([2H])([2H])N(c4cccc(Cl)c4Cl)C1([2H])[2H]

InChI

InChI=1S/C23H25Cl2N3O2.ClH/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18;/h3-9,16H,1-2,10-15H2,(H,26,29);1H/i11D2,12D2,13D2,14D2;

IUPAC

7-[4-[2,2,3,3,5,5,6,6-octadeuterio-4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-1H-quinolin-2-one;hydrochloride

Unlabelled CAS Number

1008531-60-9

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Dry Pack

Country of Origin

CANADA

Product Type

Metabolite; Stable Isotope Labelled

Product Format

Neat

API Family

Aripiprazole

Purity

>95% (HPLC)